1-[[3,4-bis(fluoranyl)phenyl]methyl]-4-(4-cyanophenyl)-2-methyl-5-propyl-pyrrole-3-carboxamide

Systemtic Name: 1-[[3,4-bis(fluoranyl)phenyl]methyl]-4-(4-cyanophenyl)-2-methyl-5-propyl-pyrrole-3-carboxamide Openeye Name: 4-(4-cyanophenyl)-1-[(3,4-difluorophenyl)methyl]-2-methyl-5-propyl-pyrrole-3-carboxamide CAS Name: 4-(4-cyanophenyl)-1-[(3,4-difluorophenyl)methyl]-2-methyl-5-propyl-3-pyrrolecarboxamide IUPAC Name: 4-(4-cyanophenyl)-1-[(3,4-difluorophenyl)methyl]-2-methyl-5-propylpyrrole-3-carboxamide Traditional Name: 4-(4-cyanophenyl)-1-(3,4-difluorobenzyl)-2-methyl-5-propyl-pyrrole-3-carboxamide Formula: C23H21F2N3O MolecularWeight: 393.429146

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C(N1CC2=CC(=C(C=C2)F)F)C)C(=O)N)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCC1=C(C(=C(N1CC2=CC(=C(C=C2)F)F)C)C(=O)N)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C23H21F2N3O/c1-3-4-20-22(17-8-5-15(12-26)6-9-17)21(23(27)29)14(2)28(20)13-16-7-10-18(24)19(25)11-16/h5-11H,3-4,13H2,1-2H3,(H2,27,29)